5-bromanyl-2-chloranyl-N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 5-bromo-2-chloro-N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 5-bromo-2-chloro-N-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 5-bromo-2-chloro-N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C20H18BrClN2O2 MolecularWeight: 433.72612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=C(C=CC(=C4)Br)Cl

Isomeric SMILES

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=C(C=CC(=C4)Br)Cl

InChI

InChI=1S/C20H18BrClN2O2/c21-15-4-6-18(22)17(10-15)19(25)23-16-5-3-12-7-8-24(11-14(12)9-16)20(26)13-1-2-13/h3-6,9-10,13H,1-2,7-8,11H2,(H,23,25)